[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (2S)-2-chloranylpropanoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (2S)-2-chloranylpropanoate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] (2S)-2-chloropropanoate CAS Name: (2S)-2-chloropropanoic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] (2S)-2-chloropropanoate Traditional Name: (2S)-2-chloropropionic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C13H23ClO2 MolecularWeight: 246.77352

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C(C)Cl)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)[C@H](C)Cl)C(C)C

InChI

InChI=1S/C13H23ClO2/c1-8(2)11-6-5-9(3)7-12(11)16-13(15)10(4)14/h8-12H,5-7H2,1-4H3/t9-,10+,11+,12-/m1/s1